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Compound Detail

CHEMBL1192969

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CNCCSc1nc2ccccc2cc1-c1ccccc1

Basic Information

ChEMBL ID CHEMBL1192969
Phase Preclinical
Structure Type MOL
InChI Key YOGYPGYLBUVWJR-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

294.4
MW (Da)
4.21
ALogP
3
HBA
1
HBD
24.9
PSA (Ų)
0.56
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H18N2S
MW 294.42
Aromatic Rings 3
Heavy Atoms 21
NP-Likeness -0.76

Data from ChEMBL 36 via Core Engine